methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate

C9H12N2O3 — CID 10774260

IUPACmethyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate
SMILESCNc1ccc(C(=O)OC)c(OC)n1
InChIInChI=1S/C9H12N2O3/c1-10-7-5-4-6(9(12)14-3)8(11-7)13-2/h4-5H,1-3H3,(H,10,11)
InChIKeyKHJXMKQYEBDPJC-UHFFFAOYSA-N
MW196.21 g/mol
LogP0.92
Rot. Bonds3

About methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate

methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate (PubChem CID 10774260) has the molecular formula C9H12N2O3 and a molecular weight of 196.21 g/mol. Its IUPAC name is methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate
PubChem CID10774260
Molecular FormulaC9H12N2O3
Molecular Weight196.21 g/mol
Exact Mass196.08
IUPAC Namemethyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate
SMILESCNc1ccc(C(=O)OC)c(OC)n1
InChIInChI=1S/C9H12N2O3/c1-10-7-5-4-6(9(12)14-3)8(11-7)13-2/h4-5H,1-3H3,(H,10,11)
InChIKeyKHJXMKQYEBDPJC-UHFFFAOYSA-N
XLogP0.92
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate?
The IUPAC name of methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate (CID 10774260) is methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate.
What is the SMILES notation for methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate?
The canonical SMILES for methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate is CNc1ccc(C(=O)OC)c(OC)n1.
What is the InChIKey of methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate?
The InChIKey is KHJXMKQYEBDPJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O3/c1-10-7-5-4-6(9(12)14-3)8(11-7)13-2/h4-5H,1-3H3,(H,10,11).
What are the key properties of methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate?
methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate has a molecular weight of 196.21 g/mol, XLogP of 0.92, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methoxy-6-(methylamino)pyridine-3-carboxylate is sourced from PubChem (CID 10774260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).